data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11339_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 -2.94 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.35 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 4.57 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 HIS 5.81 7.41 0 10 GLN 0.27 0.21 1 11 LYS 0.12 0.25 1 12 GLU -0.22 0.09 1 13 ILE -0.47 -0.44 1 14 SER -1.24 -0.10 1 15 THR 5.82 4.53 1 16 GLU 4.93 4.05 1 17 GLU 2.87 2.22 1 18 GLN 3.42 3.73 1 19 LEU 3.76 3.12 1 20 ARG 4.53 3.43 1 21 ARG 4.47 3.50 1 22 LEU 3.07 2.77 1 23 GLN 4.48 3.25 1 24 GLU 3.15 2.61 1 25 GLU 2.41 1.97 1 26 LYS 0.45 0.43 1 27 LEU -1.81 -0.12 1 29 LYS 1.69 0.39 1 30 ILE 4.36 2.07 1 32 MET 4.49 1.27 1 33 ASP -2.19 1.13 1 34 ARG -3.49 -0.81 1 35 ASN -0.63 -0.35 1 36 ILE 2.79 2.58 1 37 ALA -5.16 -0.30 1 38 ILE -5.09 -4.44 1 39 VAL -4.31 -2.82 1 40 PHE -3.51 -3.65 1 41 VAL -3.20 -1.20 1 46 LEU -1.44 -1.62 1 47 VAL -3.90 -0.92 1 48 THR -6.03 -2.45 1 50 LYS 4.91 4.33 1 51 GLN 5.43 4.54 1 53 ALA 1.61 2.04 1 54 GLU 2.62 2.61 1 55 ALA -0.83 -0.12 1 56 VAL -2.38 -1.64 1 57 ASP -1.75 -0.68 1 58 LYS -4.60 -2.25 1 61 MET 1.81 0.60 1 63 TYR 5.34 1.63 1 64 THR 3.24 2.20 1 65 VAL 3.94 2.92 1 66 ILE -1.11 -0.10 1 67 THR 2.69 1.63 1 68 PHE -1.56 0.81 1 69 LYS -1.07 -1.06 1 70 GLN -3.15 -2.20 1 71 LYS 1.18 0.77 1 72 ILE -3.71 -2.13 1 73 PHE -1.90 0.02 1 74 MET -0.43 -0.09 1 75 SER 0.51 1.59 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11339_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 3.09 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.63 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.65 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 -1.24 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 HIS 5.81 1.60 0 10 GLN 0.27 -0.06 1 11 LYS 0.12 0.13 1 12 GLU -0.22 0.31 1 13 ILE -0.47 0.03 1 14 SER -1.24 1.14 1 15 THR 5.82 -1.29 1 16 GLU 4.93 -0.88 1 17 GLU 2.87 -0.65 1 18 GLN 3.42 0.31 1 19 LEU 3.76 -0.64 1 20 ARG 4.53 -1.10 1 21 ARG 4.47 -0.97 1 22 LEU 3.07 -0.30 1 23 GLN 4.48 -1.23 1 24 GLU 3.15 -0.54 1 25 GLU 2.41 -0.44 1 26 LYS 0.45 -0.02 1 27 LEU -1.81 1.69 1 29 LYS 1.69 -1.30 1 30 ILE 4.36 -2.29 1 32 MET 4.49 -3.22 1 33 ASP -2.19 3.32 1 34 ARG -3.49 2.68 1 35 ASN -0.63 0.28 1 36 ILE 2.79 -0.21 1 37 ALA -5.16 4.86 1 38 ILE -5.09 0.65 1 39 VAL -4.31 1.49 1 40 PHE -3.51 -0.14 1 41 VAL -3.20 2.00 1 46 LEU -1.44 -0.18 1 47 VAL -3.90 2.98 1 48 THR -6.03 3.58 1 50 LYS 4.91 -0.58 1 51 GLN 5.43 -0.89 1 53 ALA 1.61 0.43 1 54 GLU 2.62 -0.01 1 55 ALA -0.83 0.71 1 56 VAL -2.38 0.74 1 57 ASP -1.75 1.07 1 58 LYS -4.60 2.35 1 61 MET 1.81 -1.21 1 63 TYR 5.34 -3.71 1 64 THR 3.24 -1.04 1 65 VAL 3.94 -1.02 1 66 ILE -1.11 1.01 1 67 THR 2.69 -1.06 1 68 PHE -1.56 2.37 1 69 LYS -1.07 0.01 1 70 GLN -3.15 0.95 1 71 LYS 1.18 -0.41 1 72 ILE -3.71 1.58 1 73 PHE -1.90 1.92 1 74 MET -0.43 0.34 1 75 SER 0.51 1.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11339_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 0.46 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 -0.43 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 THR -6.03 2.28 0 10 GLN 0.27 -0.05 1 11 LYS 0.12 -0.05 1 12 GLU -0.22 -0.08 1 13 ILE -0.47 0.11 1 14 SER -1.24 0.02 1 15 THR 5.82 -0.54 1 16 GLU 4.93 -0.52 1 17 GLU 2.87 -0.20 1 18 GLN 3.42 -0.41 1 19 LEU 3.76 -0.39 1 20 ARG 4.53 -0.31 1 21 ARG 4.47 -0.31 1 22 LEU 3.07 -0.27 1 23 GLN 4.48 -0.36 1 24 GLU 3.15 -0.42 1 25 GLU 2.41 -0.25 1 26 LYS 0.45 -0.17 1 27 LEU -1.81 -0.08 1 29 LYS 1.69 -0.11 1 30 ILE 4.36 -0.02 1 32 MET 4.49 -0.09 1 33 ASP -2.19 0.24 1 34 ARG -3.49 0.03 1 35 ASN -0.63 0.35 1 36 ILE 2.79 -1.02 1 37 ALA -5.16 0.14 1 38 ILE -5.09 0.66 1 39 VAL -4.31 0.34 1 40 PHE -3.51 0.60 1 41 VAL -3.20 0.07 1 45 HIS 5.81 0.14 1 46 LEU -1.44 0.51 1 47 VAL -3.90 0.53 1 50 LYS 4.91 -0.49 1 51 GLN 5.43 -0.30 1 53 ALA 1.61 -0.16 1 54 GLU 2.62 -0.42 1 55 ALA -0.83 0.06 1 56 VAL -2.38 0.34 1 57 ASP -1.75 0.11 1 58 LYS -4.60 0.23 1 61 MET 1.81 -0.15 1 63 TYR 5.34 -0.30 1 64 THR 3.24 -0.14 1 65 VAL 3.94 -0.43 1 66 ILE -1.11 -0.02 1 67 THR 2.69 0.01 1 68 PHE -1.56 0.06 1 69 LYS -1.07 0.26 1 70 GLN -3.15 0.13 1 71 LYS 1.18 0.29 1 72 ILE -3.71 0.93 1 73 PHE -1.90 -0.08 1 74 MET -0.43 0.19 1 75 SER 0.51 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11339_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.03 _LACS_plot.Line_1_terminator_val_y_1 -2.36 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.99 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 2.04 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 THR -6.03 1.43 0 10 GLN 0.27 -0.17 1 11 LYS 0.12 -0.13 1 12 GLU -0.22 -0.36 1 13 ILE -0.47 -0.07 1 14 SER -1.24 0.88 1 15 THR 5.82 1.48 1 16 GLU 4.93 2.32 1 17 GLU 2.87 2.11 1 18 GLN 3.42 2.86 1 19 LEU 3.76 0.01 1 20 ARG 4.53 2.85 1 21 ARG 4.47 3.06 1 22 LEU 3.07 2.47 1 23 GLN 4.48 3.95 1 24 GLU 3.15 2.83 1 25 GLU 2.41 0.49 1 26 LYS 0.45 -0.85 1 27 LEU -1.81 -1.39 1 29 LYS 1.69 0.09 1 30 ILE 4.36 0.50 1 32 MET 4.49 -1.36 1 33 ASP -2.19 -1.27 1 34 ARG -3.49 -1.61 1 35 ASN -0.63 1.35 1 36 ILE 2.79 -0.46 1 37 ALA -5.16 -3.24 1 38 ILE -5.09 -1.13 1 39 VAL -4.31 -2.48 1 40 PHE -3.51 -1.69 1 41 VAL -3.20 1.57 1 45 HIS 5.81 0.75 1 46 LEU -1.44 -2.72 1 47 VAL -3.90 -1.89 1 50 LYS 4.91 1.48 1 51 GLN 5.43 3.86 1 53 ALA 1.61 2.06 1 54 GLU 2.62 0.36 1 55 ALA -0.83 -0.31 1 56 VAL -2.38 -2.05 1 57 ASP -1.75 -0.43 1 58 LYS -4.60 -2.17 1 61 MET 1.81 0.18 1 63 TYR 5.34 -1.73 1 64 THR 3.24 0.20 1 65 VAL 3.94 -0.84 1 66 ILE -1.11 0.67 1 67 THR 2.69 0.43 1 68 PHE -1.56 -3.74 1 69 LYS -1.07 -3.11 1 70 GLN -3.15 -1.75 1 71 LYS 1.18 -0.15 1 72 ILE -3.71 -0.92 1 73 PHE -1.90 -0.50 1 74 MET -0.43 -1.30 1 75 SER 0.51 3.65 1 stop_ save_